B8SEN1 -OEChem-04012115222D 45 47 0 0 0 0 0 0 0999 V2000 3.8366 0.8095 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.6851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8594 5.3760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 2.0354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.6851 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6456 -0.5918 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3092 0.0468 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8147 1.0174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6337 2.7399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2215 1.9309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0404 3.6535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6392 2.6354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.1851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.1851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4526 4.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0514 3.4444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4581 4.3580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.1851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.1851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2716 6.1851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.3751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.8751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.8751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6570 3.7183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3870 2.0690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.4951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.4951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4348 3.3796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0937 4.8596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -4.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -5.2927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5614 -0.5196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6737 0.5484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -6.1851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.8051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -6.1851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7732 6.5495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9072 6.6866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 5.8206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 11 1 0 0 0 0 2 16 1 0 0 0 0 2 24 1 0 0 0 0 3 21 1 0 0 0 0 3 26 1 0 0 0 0 4 12 2 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 5 27 1 0 0 0 0 6 11 2 0 0 0 0 6 13 1 0 0 0 0 7 13 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 12 1 0 0 0 0 8 13 2 0 0 0 0 9 14 2 0 0 0 0 9 15 1 0 0 0 0 10 12 1 0 0 0 0 10 17 2 0 0 0 0 10 18 1 0 0 0 0 14 19 1 0 0 0 0 14 28 1 0 0 0 0 15 20 2 0 0 0 0 15 29 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 17 21 1 0 0 0 0 17 30 1 0 0 0 0 18 22 2 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 21 23 2 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 24 25 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END $$$$